SCHEMBL18360387

SCHEMBL18360387

CCCCOC(=O)[C@H](C)OC(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.45
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CTSS P25774 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
ACHE P22303 6/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18668826 0.86 MEN1 (0.40) CTSKCA12CA1CA2CA9
SCHEMBL21168987 0.86 CA2 (0.39) CTSKCA12CA1CA2CA9
SCHEMBL18360392 0.86 MEN1 (0.44) CTSKCA12CA1CA2CA9
SCHEMBL18687105 0.85 CYP1A2 (0.48) CTSKCA1CA2CTSSMEN1
SCHEMBL22971405 0.85 CYP1A2 (0.48) CTSKCA1CA2CTSSMEN1
SCHEMBL28542473 0.85 CA12 (0.41) CTSKCA12CA1CA2CA9
SCHEMBL18686249 0.84 ALDH1A1 (0.44) ACHEALDH1A1TSHRNPC1RAB9A
SCHEMBL1710035 0.84 CA12 (0.48) CTSKCA12CA1CA2CA9
SCHEMBL18686246 0.81 MEN1 (0.41) CTSKCA12CA1CA2CA9
SCHEMBL16124577 0.79 CA12 (0.50) CTSKCA12CA1CA2CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170001948-A1 DIAMINE CROSSLINKING AGENTS, CROSSLINKED ACIDIC POLYSACCHARIDES AND MEDICAL MATERIALS SEIKAGAKU CORPORATION (JP) 2017-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170001948-A1 DIAMINE CROSSLINKING AGENTS, CROSSLINKED ACIDIC POLYSACCHARIDES AND MEDICAL MATERIALS SAT1, ACMSD, ADM2 CTSK 4211/4885CA12 71/4885CA1 169/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.